Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-
TL;DR: Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- (CAS 16239-90-0) is a chemical compound with molecular formula C8H7N3O3 and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-(5-nitrofuran-2-yl)-1H-pyrazole
Also Known As: Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-, 5-Methyl-3-(5-nitro-2-furyl)pyrazole, 5-methyl-3-(5-nitrofuran-2-yl)-1H-pyrazole, Pyrazole, 3-methyl-5-(5-nitro-2-furyl)-, 5-{5-nitro-2-furyl}-3-methyl-1H-pyrazole
| Molecular Formula | C8H7N3O3 |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.04874 |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 16239-90-0 |
|---|---|
| SMILES | CC1=CC(=NN1)C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | KABMWDLFVZLTKU-UHFFFAOYSA-N |
Product Overview
Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- (CAS 16239-90-0), with molecular formula C8H7N3O3 and molecular weight 193.05 g/mol. IUPAC: 5-methyl-3-(5-nitrofuran-2-yl)-1H-pyrazole.
Chemical Property Profile of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-
Property Insights of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-. Following Lipinski's Rule of Five, Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-?
The CAS number of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- is 16239-90-0.
What is the molecular formula of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-?
The molecular formula of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- is C8H7N3O3.
What is the molecular weight of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-?
The molecular weight of Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- is 193.05 g/mol.
Where can I buy Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-?
You can request a quote for Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole, 5-methyl-3-(5-nitro-2-furyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole, 5-methyl-3-(5-nitro-2-furyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.